N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-[(2-morpholinosulfonylphenyl)methyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-[(2-morpholin-4-ylsulfonylphenyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-(2-morpholinosulfonylbenzyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H24N2O4S2/c23-20(18-13-15-5-1-3-7-17(15)27-18)21-14-16-6-2-4-8-19(16)28(24,25)22-9-11-26-12-10-22/h2,4,6,8,13H,1,3,5,7,9-12,14H2,(H,21,23)